graspgtest
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graspgtest
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All the GRASP and GRASPG programs are assumed that they could be found in ${PATH}.
To perform the test calculations, please take a quick look at run.sh of the corresponding directory.
The codes and scripts have been tested using a server with:
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CentOS Linux release 7.9.2009,
gcc-12.2.0,
openmpi-4.1.5,
lapack-3.11.0
64 cores of parallel computer system equipped with two AMD 218 EPYC
7542 central processing units (CPUs).
by Fudan Atomic Spectroscopy Theory Group (FASTG)
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